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Propantheline bromide
SpectraBase Compound ID 4rCFQf7wQM3
InChI InChI=1S/C23H30NO3.BrH/c1-16(2)24(5,17(3)4)14-15-26-23(25)22-18-10-6-8-12-20(18)27-21-13-9-7-11-19(21)22;/h6-13,16-17,22H,14-15H2,1-5H3;1H/q+1;/p-1
InChIKey XLBIBBZXLMYSFF-UHFFFAOYSA-M
Mol Weight 448.4 g/mol
Molecular Formula C23H30BrNO3
Exact Mass 447.140907 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID GHhRAvVgYgV
Name Propantheline bromide
Source of Sample Cayman Chemical Company
Catalog Number 23609
Lot Number 0518449-1
Accessory DurasamplIR II
Apodization Function Norton-Beer, medium
CAS Registry Number 50-34-0
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Formula C23H30BrNO3
IUPAC Name N-Methyl-N-(1-methylethyl)-N-[2-[(9H-xanthen-9-ylcarbonyl)oxy]ethyl]-2-propanaminium, monobromide
InChI InChI=1S/C23H30NO3.BrH/c1-16(2)24(5,17(3)4)14-15-26-23(25)22-18-10-6-8-12-20(18)27-21-13-9-7-11-19(21)22;/h6-13,16-17,22H,14-15H2,1-5H3;1H/q+1;/p-1
InChIKey XLBIBBZXLMYSFF-UHFFFAOYSA-M
Instrument Name Bio-Rad FTS
SMILES c12ccccc1Oc1ccccc1C2C(OCC[N+](C(C)C)(C(C)C)C)=O.[Br-]
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms SC-3171
Technique ATR-Neat